SCHEMBL24113751

SCHEMBL24113751

Cc1cc(F)cc(C)c1OCCCOc1c(C)cc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN8A Q9UQD0 4/20 0.39
FFAR4 Q5NUL3 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
PLAU P00749 1/20 0.33
LMNA P02545 2/20 0.33
USP2 O75604 1/20 0.33
ALOX15 P16050 1/20 0.33
MAPK1 P28482 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
FFAR1 O14842 1/20 0.32
GRIN2D O15399 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20684327 0.92 SCN8A (0.42) SCN8AFFAR4KMT2AMEN1KDM4E
SCHEMBL24113746 0.87 SCN8A (0.33) SCN8AFFAR4KMT2AMEN1KDM4E
SCHEMBL24113750 0.85 MRGPRX4 (0.40) SCN8AKDM4EMAPTL3MBTL1LMNA
SCHEMBL16333319 0.84 SCN8A (0.32) SCN8AMAPTL3MBTL1GRIN2DGRIN3B
SCHEMBL25436252 0.82 SCN8A (0.40) SCN8AFFAR4KMT2AMEN1KDM4E
SCHEMBL17689130 0.82 GRIN2D (0.38) KDM4EALDH1A1CYP1A2CYP2D6MAPT
SCHEMBL22593864 0.79 SCN8A (0.36) SCN8AFFAR4KMT2AMEN1KDM4E
SCHEMBL21777805 0.78 MAPT (0.49) KMT2AMEN1KDM4EALDH1A1CYP1A2
SCHEMBL814826 0.78 SCN8A (0.35) SCN8AKMT2AMEN1KDM4EALDH1A1
SCHEMBL29864603 0.78 SCN8A (0.35) SCN8AKMT2AMEN1KDM4EALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3925989-A1 MOLECULAR WEIGHT CONTROL OF POLYOLEFINS USING HALOGENATED BIS-PHENYLPHENOXY CATALYSTS Dow Global Technologies LLC (US) 2021-12-22 EP disclosed